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BDBM50299973 CHEMBL572374::Octanedioic Acid [4-(3-Azidophenyl)thiazol-2-yl]amide Hydroxyamide

SMILES: ONC(=O)CCCCCCC(=O)Nc1nc(cs1)-c1ccc(cc1)N=[N+]=[N-]

InChI Key: InChIKey=ABPLIEJUZKFIIC-UHFFFAOYSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50299973   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50299973
PNG
(CHEMBL572374 | Octanedioic Acid [4-(3-Azidophenyl)...)
Show SMILES ONC(=O)CCCCCCC(=O)Nc1nc(cs1)-c1ccc(cc1)N=[N+]=[N-]
Show InChI InChI=1S/C17H20N6O3S/c18-23-21-13-9-7-12(8-10-13)14-11-27-17(19-14)20-15(24)5-3-1-2-4-6-16(25)22-26/h7-11,26H,1-6H2,(H,22,25)(H,19,20,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
2.43E+3n/an/an/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC8 using fluorescent acetylated substrate


J Med Chem 52: 7003-13 (2009)


Article DOI: 10.1021/jm9005077
BindingDB Entry DOI: 10.7270/Q2ST7PWM
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50299973
PNG
(CHEMBL572374 | Octanedioic Acid [4-(3-Azidophenyl)...)
Show SMILES ONC(=O)CCCCCCC(=O)Nc1nc(cs1)-c1ccc(cc1)N=[N+]=[N-]
Show InChI InChI=1S/C17H20N6O3S/c18-23-21-13-9-7-12(8-10-13)14-11-27-17(19-14)20-15(24)5-3-1-2-4-6-16(25)22-26/h7-11,26H,1-6H2,(H,22,25)(H,19,20,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.71E+3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC8 using fluorescent acetylated substrate


J Med Chem 52: 7003-13 (2009)


Article DOI: 10.1021/jm9005077
BindingDB Entry DOI: 10.7270/Q2ST7PWM
More data for this
Ligand-Target Pair